(1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene

C16H16O — CID 132584955

IUPAC(1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene
SMILESCOc1ccc([C@H]2CCc3ccccc32)cc1
InChIInChI=1S/C16H16O/c1-17-14-9-6-13(7-10-14)16-11-8-12-4-2-3-5-15(12)16/h2-7,9-10,16H,8,11H2,1H3/t16-/m1/s1
InChIKeyAGEMRMUQTABLGA-MRXNPFEDSA-N
MW224.30 g/mol
LogP3.77
Rot. Bonds2

About (1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene

(1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene (PubChem CID 132584955) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is (1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name(1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene
PubChem CID132584955
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name(1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene
SMILESCOc1ccc([C@H]2CCc3ccccc32)cc1
InChIInChI=1S/C16H16O/c1-17-14-9-6-13(7-10-14)16-11-8-12-4-2-3-5-15(12)16/h2-7,9-10,16H,8,11H2,1H3/t16-/m1/s1
InChIKeyAGEMRMUQTABLGA-MRXNPFEDSA-N
XLogP3.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene?
The IUPAC name of (1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene (CID 132584955) is (1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene.
What is the SMILES notation for (1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene?
The canonical SMILES for (1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene is COc1ccc([C@H]2CCc3ccccc32)cc1.
What is the InChIKey of (1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene?
The InChIKey is AGEMRMUQTABLGA-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H16O/c1-17-14-9-6-13(7-10-14)16-11-8-12-4-2-3-5-15(12)16/h2-7,9-10,16H,8,11H2,1H3/t16-/m1/s1.
What are the key properties of (1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene?
(1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene has a molecular weight of 224.30 g/mol, XLogP of 3.77, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene is sourced from PubChem (CID 132584955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).